5-(2-phenoxysulfanylcarbonyloxyethyl)-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-(2-phenoxysulfanylcarbonyloxyethyl)-1,2-oxazole-3-carboxylic acid Openeye Name: 5-(2-phenoxysulfanylcarbonyloxyethyl)isoxazole-3-carboxylic acid CAS Name: 5-[2-[oxo-(phenoxythio)methoxy]ethyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-(2-phenoxysulfanylcarbonyloxyethyl)-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[2-(phenoxythio)carbonyloxyethyl]isoxazole-3-carboxylic acid Formula: C13H11NO6S MolecularWeight: 309.29454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OSC(=O)OCCC2=CC(=NO2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OSC(=O)OCCC2=CC(=NO2)C(=O)O

InChI

InChI=1S/C13H11NO6S/c15-12(16)11-8-10(19-14-11)6-7-18-13(17)21-20-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,15,16)